3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine

C10H20N2O — CID 134452695

IUPAC3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine
SMILESCOC1CN(C2CN(C(C)C)C2)C1
InChIInChI=1S/C10H20N2O/c1-8(2)11-4-9(5-11)12-6-10(7-12)13-3/h8-10H,4-7H2,1-3H3
InChIKeyGHSBSQIMVUTMKZ-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.41
Rot. Bonds3

About 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine

3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine (PubChem CID 134452695) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine.

Molecular Properties

Compound Name3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine
PubChem CID134452695
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine
SMILESCOC1CN(C2CN(C(C)C)C2)C1
InChIInChI=1S/C10H20N2O/c1-8(2)11-4-9(5-11)12-6-10(7-12)13-3/h8-10H,4-7H2,1-3H3
InChIKeyGHSBSQIMVUTMKZ-UHFFFAOYSA-N
XLogP0.41
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine?
The IUPAC name of 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine (CID 134452695) is 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine.
What is the SMILES notation for 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine?
The canonical SMILES for 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine is COC1CN(C2CN(C(C)C)C2)C1.
What is the InChIKey of 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine?
The InChIKey is GHSBSQIMVUTMKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(2)11-4-9(5-11)12-6-10(7-12)13-3/h8-10H,4-7H2,1-3H3.
What are the key properties of 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine?
3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine has a molecular weight of 184.28 g/mol, XLogP of 0.41, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-(1-propan-2-ylazetidin-3-yl)azetidine is sourced from PubChem (CID 134452695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).